ChemDB: Chemical Search
Download
Chemical ID: 4253292
Chemical ID:
4253292
Name [?]:
2-morpholino-2-phenyl-ethanamine
SMILES [?]:
c1ccc(cc1)C(CN)N2CCOCC2
InChi [?]:
InChI=1/C12H18N2O/c13-10-12(11-4-2-1-3-5-11)14-6-8-15-9-7-14/h1-5,12H,6-10,13H2
InChi Info:
AuxInfo=1/0/N:1,2,6,3,5,11,15,12,14,8,4,7,9,10,13/E:(2,3)(4,5)(6,7)(8,9)/rA:15cCCCCCCCCNNCCOCC/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s7;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H18N2O |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 6.91574 |
Area: | 375.822 |
Solvation: | -2.47981 |
Coulombic: | -27.0624 |
Bond Count [?]
All: | 16 |
Single: | 13 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 206.284 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 3 |
XLogP: | 0.7 |
LogP (Chemaxon): | 0.87 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|